Debasis Sengupta

Development of a ReaxFF Reactive Force Field for Fe/Cr/O/S and Application to Oxidation of Butane over a Pyrite-Covered Cr₂O₃ Catalyst

Yun Kyung Shin, H. Shaun Kwak, Alex V. Vasenkov et al. · ACS Catalysis · 2015 · 193 citations

Materials Science, Oxygen Reduction Reaction, Chemical Engineering +12

Theoretical Study of the Thermal Decomposition of Acetic Acid: Decarboxylation Versus Dehydration

Minh Tho Nguyen, Debasis Sengupta, Greet Raspoet et al. · The Journal of Physical Chemistry · 1995 · 104 citations

Engineering, Chemical Analysis, Altmetric Attention Score +16

Combined ab initio quantum chemistry and computational fluid dynamics calculations for prediction of gallium nitride growth

Debasis Sengupta, Sandip Mazumder, William Kuykendall et al. · Journal of Crystal Growth · 2005 · 79 citations

Engineering, Physics, Natural Sciences +9

Theoretical Study of the H₂ + NO and Related Reactions of [H₂NO] Isomers

R. Sumathi, Debasis Sengupta, Minh Tho Nguyen · The Journal of Physical Chemistry A · 1998 · 70 citations

Engineering, Computational Chemistry, Chemistry +20

Does the Ring Compound [(CH₃)₂GaNH₂]₃ Form during MOVPE of Gallium Nitride? Investigations via Density Functional and Reaction Rate Theories

Debasis Sengupta · The Journal of Physical Chemistry B · 2002 · 52 citations

Wide-bandgap Semiconductor, Reaction Rate Theories, Engineering +16